6-methyl-4-[4-[4-(2-methylpropyl)phenoxy]but-2-ynoxy]pyran-2-thione

Systemtic Name: 6-methyl-4-[4-[4-(2-methylpropyl)phenoxy]but-2-ynoxy]pyran-2-thione Openeye Name: 4-[4-(4-isobutylphenoxy)but-2-ynoxy]-6-methyl-pyran-2-thione CAS Name: 6-methyl-4-[4-[4-(2-methylpropyl)phenoxy]but-2-ynoxy]-2-pyranthione IUPAC Name: 6-methyl-4-[4-[4-(2-methylpropyl)phenoxy]but-2-ynoxy]pyran-2-thione Traditional Name: 4-[4-(4-isobutylphenoxy)but-2-ynoxy]-6-methyl-pyran-2-thione Formula: C20H22O3S MolecularWeight: 342.45188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=S)O1)OCC#CCOC2=CC=C(C=C2)CC(C)C

Isomeric SMILES

CC1=CC(=CC(=S)O1)OCC#CCOC2=CC=C(C=C2)CC(C)C

InChI

InChI=1S/C20H22O3S/c1-15(2)12-17-6-8-18(9-7-17)21-10-4-5-11-22-19-13-16(3)23-20(24)14-19/h6-9,13-15H,10-12H2,1-3H3